Products 67022-39-3

CAS 67022-39-3 appears in our catalog under these names: Methotrexate EP Impurity H, Methotrexate EP Impurity H (Methotrexate-5-Monomethyl Ester), Methotrexate gamma-Methyl Ester, >95% (HPLC), (2S)-2-((4-(((2,4-Diaminopteridin-6-yl)methyl)methylamino)benzoyl)amino)-5-methoxy-5-oxopentanoic Acid (Methotrexate 5-Methyl Ester), Methotrexate-5-monomethyl ester. Offered by: Chemat Brand, TRC, Mikromol, Biosynth, MedChemExpress. Available pack sizes: on request, 500mg, 50mg, 25mg, 10mg, 5mg, 100mg, 1 mg.

Structural formula: {0} (CAS {1})

(2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-methoxy-5-oxopentanoic acid (CAS 67022-39-3) is a chemical compound with the molecular formula C21H24N8O5 and a molecular weight of 468.5 g/mol. IUPAC name: (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-methoxy-5-oxopentanoic acid. InChIKey: RYGFOBBTCUXHBB-AWEZNQCLSA-N.

Identity
Molecular formulaC21H24N8O5
Molecular weight468.5 g/mol
IUPAC name(2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]-5-methoxy-5-oxopentanoic acid
InChIKeyRYGFOBBTCUXHBB-AWEZNQCLSA-N
SMILESCN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=O)OC)C(=O)O

Computed by PubChem (NCBI)